(1R,6S)-6-[[4-(4-ethylphenyl)-3-propan-2-yloxycarbonyl-thiophen-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-6-[[4-(4-ethylphenyl)-3-propan-2-yloxycarbonyl-thiophen-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-[[4-(4-ethylphenyl)-3-isopropoxycarbonyl-2-thienyl]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[[[4-(4-ethylphenyl)-3-[oxo(propan-2-yloxy)methyl]-2-thiophenyl]amino]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-[[4-(4-ethylphenyl)-3-propan-2-yloxycarbonylthiophen-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-[[4-(4-ethylphenyl)-3-isopropoxycarbonyl-2-thienyl]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C24H26NO5S- MolecularWeight: 440.53194

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC(C)C)NC(=O)C3CC=CCC3C(=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC(C)C)NC(=O)[C@H]3CC=CC[C@H]3C(=O)[O-]

InChI

InChI=1S/C24H27NO5S/c1-4-15-9-11-16(12-10-15)19-13-31-22(20(19)24(29)30-14(2)3)25-21(26)17-7-5-6-8-18(17)23(27)28/h5-6,9-14,17-18H,4,7-8H2,1-3H3,(H,25,26)(H,27,28)/p-1/t17-,18+/m0/s1